Y030-9942 Screening compound: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-(ethylsulfanyl)benzamide

Y030-9942 Screening compound: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-(ethylsulfanyl)benzamide
Y030-9942 Screening compound: N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-(ethylsulfanyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-9942
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-(ethylsulfanyl)benzamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

Y030-9942

Molecular Formula

C15H19N3OS2 (C15 H19 N3 OS2)

Compound Name

N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-(ethylsulfanyl)benzamide

IUPAC name

N-(5-tert-butyl-134-thiadiazol-2-yl)-2-(ethylsulfanyl)benzamide

SMILES

CCSc(cccc1)c1C(Nc1nnc(C(C)(C)C)s1)=O

InChI

InChI=1S/C15H19N3OS2/c1-5-20-11-9-7-6-8-10(11)12(19)16-14-18-17-13(21-14)15(2,3)4/h6-9H,5H2,1-4H3,(H,16,18,19)

InChI Key

DNIBGVIPMQPRCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04278732

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.422

Distribution Coefficient, logD

3.460

Water Solubility, LogSw

-4.33

Polar Surface Area

46.875

Acid Dissociation Constant (pKa)

6.49

Base Dissociation Constant (pKb)

-1.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

Y030-9942 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y030-9942 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-9942?
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What is the minimum amount of Y030-9942 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-9942
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-9942
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of Y030-9942 available by request